6-[[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-(1-methylimidazol-4-yl)sulfonyl-amino]hexanamide

Systemtic Name: 6-[[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-(1-methylimidazol-4-yl)sulfonyl-amino]hexanamide Openeye Name: 6-[[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-(1-methylimidazol-4-yl)sulfonyl-amino]hexanamide CAS Name: 6-[[6-cyano-1-[(3-methyl-4-imidazolyl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-[(1-methyl-4-imidazolyl)sulfonyl]amino]hexanamide IUPAC Name: 6-[[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-(1-methylimidazol-4-yl)sulfonylamino]hexanamide Traditional Name: 6-[[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-(1-methylimidazol-4-yl)sulfonyl-amino]hexanamide Formula: C25H32N8O3S MolecularWeight: 524.63838

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C1)S(=O)(=O)N(CCCCCC(=O)N)C2CC3=C(C=CC(=C3)C#N)N(C2)CC4=CN=CN4C

Isomeric SMILES

CN1C=C(N=C1)S(=O)(=O)N(CCCCCC(=O)N)C2CC3=C(C=CC(=C3)C#N)N(C2)CC4=CN=CN4C

InChI

InChI=1S/C25H32N8O3S/c1-30-16-25(29-18-30)37(35,36)33(9-5-3-4-6-24(27)34)21-11-20-10-19(12-26)7-8-23(20)32(14-21)15-22-13-28-17-31(22)2/h7-8,10,13,16-18,21H,3-6,9,11,14-15H2,1-2H3,(H2,27,34)